Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLMPHSAALNAARRSADLTALADGGALDVIVIGGGITGVGIALDAATRGLTVALVEKHDLAFGTSRWSSKLVHGGLRYLASGNVGIARRSAVERGILMTRNAPHLVHAMPQLVPLLPSMGHTKRALVRAGFLAGDALRVLAGTPAATLPRSRRIPASRVVEIAPTVRRDGLDGGLLAYDGQLIDDARLVMAVARTAAQHGARILTYVGASNVTGT-----SVELTDRRTRQSFALSARAVINAAGVWAGEIDPS------LRLRPSRGTHLVFDAKSFANPTAALTIPIPGELNRFVFAMPEQLGRIYLGLTDEDAPGPIPDVPQPSSEEITFLLDTVNTALG-TAVGTKDVIGAYAGLRPLIDTGGAGVQGRTADVSRDHAVFESPSGVISVVGGKLTEYRYMAEDVLNRAITL-RHLRAAKCRTRNLPLIGAPANPG--------------PAPGSGAGLPESLVARYGAEAANVAAAATCERPT--EPVADGIDVTRAEFEYAVTHEGALDVDDILDRRTRIGLVPRDR-----ERVVAVAKEFLSR |
3DA1 Chain:A ((6-521)) | ------------KRDKCIGEMS-EKQLDLLVIGGGITGAGIALDAQVRGIQTGLVEMNDFASGTSSRSTKLVHG---------------VGKERAIVY-ENAPHVTTPEWMLLPIFK---------------------------------RYMLNEKQTLEKEPLLRKENLKGGGIYVEYRT-DDARLTLEIMKEAVARGAVALNYMKVESFIYDQGKVVGVVAKDRLTDTTHTIYAKKVVNAAGPWVDTLREKDRSKHGKYLKLSKGVHLVVDQSRFPL-RQAVYFDTES-DGRMIFAIPRE-GKTYIGTTDTFYDKD-IASPRMTVEDRDYILAAANYMFPSLRLTADDVESSWAGLRPLIHE---------------DEIFFSDSGLISIAGGKLTGYRKMAERTVDAVAQGLNV--NEPCTTAAIRLSGGLAEGAQGFPRFLDEASRKGAKLGFDADEVRRLAKLYGSNVDHVLNYAY-EGKEEAEH-YGLPALLLGQLQYGVEQEMVATPLDFFVRRTGALFFNISLVHQWKEAVLRWMAEEFS- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3DA1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -234510 for 3701 contacts (-63.4/contact) +
2D Compatibility (PS) -46338 + (NN) -11056 + (LL) 5472
1D Compatibility (HY) -22000 + (ID) 7050
Total energy: -315482.0 ( -85.24 by residue)
QMean score : 0.485
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